Information card for entry 7160708

Structure parameters

• Formula: C26 H21 N3 O4 S
• Calculated formula: C26 H21 N3 O4 S
• Title of publication: Rhodium(II) catalysed highly diastereoselective synthesis of indolyl-pyrrolo[2,1-<i>a</i>]isoindoles from phthalimide-derived <i>N</i>-sulfonyl-1,2,3-triazoles and indoles.
• Authors of publication: Patil, Shivaji V.; Bhanage, Bhalchandra M.; Verma, Ajay; Dawande, Sudam G.
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2025
• Journal volume: 23
• Journal issue: 37
• Pages of publication: 8437 - 8441
• a: 11.7276 ± 0.0011 Å
• b: 30.773 ± 0.003 Å
• c: 7.4588 ± 0.0005 Å
• α: 90°
• β: 100.165 ± 0.004°
• γ: 90°
• Cell volume: 2649.6 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0922
• Residual factor for significantly intense reflections: 0.0508
• Weighted residual factors for significantly intense reflections: 0.1139
• Weighted residual factors for all reflections included in the refinement: 0.1278
• Goodness-of-fit parameter for all reflections included in the refinement: 0.8996
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No